new file: a/Automake/Automake-1.15.1.eb

new file:   a/Autotools/Autotools-20170619.eb
	new file:   e/ELPA/ELPA-2015.02.002-intel-2018a.eb
	new file:   e/ELPA/ELPA-2017.11.001-intel-2018a.eb
	new file:   w/WIEN2k/WIEN2k-18.2-intel-2018a.eb

a/Automake/Automake-1.15.1.eb

@@ -0,0 +1,26 @@
+# IT4Innovations 2018
+
+easyblock = 'ConfigureMake'
+
+name = 'Automake'
+version = "1.15.1"
+
+homepage = 'http://www.gnu.org/software/automake/automake.html'
+
+description = "Automake: GNU Standards-compliant Makefile generator"
+
+toolchain = {'name': 'dummy', 'version': ''}
+
+source_urls = ['https://mirror.checkdomain.de/gnu/automake/']
+sources = [SOURCELOWER_TAR_GZ]
+
+dependencies = [
+    ('Autoconf', '2.69'),
+]
+
+sanity_check_paths = {
+    'files': ['bin/automake', 'bin/aclocal'],
+    'dirs': []
+}
+
+moduleclass = 'devel'

a/Autotools/Autotools-20170619.eb

@@ -0,0 +1,24 @@
+easyblock = 'Bundle'
+
+name = 'Autotools'
+version = '20170619'  # date of the most recent change
+
+homepage = 'http://autotools.io'
+
+description = """
+ This bundle collect the standard GNU build tools: Autoconf, Automake
+ and libtool
+"""
+
+toolchain = {'name': 'dummy', 'version': ''}
+
+dependencies = [
+    ('Autoconf', '2.69'),    # 20120424
+    ('Automake', '1.15.1'),  # 20170619
+    ('libtool', '2.4.6'),    # 20150215
+]
+
+# Pure bundle -- no need to specify 'binutils' used when building GCCcore
+# toolchain as build dependency
+
+moduleclass = 'devel'

e/ELPA/ELPA-2015.02.002-intel-2018a.eb

@@ -0,0 +1,52 @@
+##
+# This file is an EasyBuild reciPY as per https://github.com/easybuilders/easybuild
+#
+# Authors::   Inge Gutheil <i.gutheil@fz-juelich.de>, Alan O'Cais <a.ocais@fz-juelich.de>
+# License::   MIT/GPL
+# $Id$
+#
+##
+
+easyblock = 'ConfigureMake'
+
+name = 'ELPA'
+version = '2015.02.002'
+
+homepage = 'http://elpa.rzg.mpg.de'
+description = """Eigenvalue SoLvers for Petaflop-Applications ."""
+
+toolchain = {'name': 'intel', 'version': '2018a'}
+toolchainopts = {'usempi': True}
+
+source_urls = ['http://elpa.mpcdf.mpg.de/html/Releases/%(version)s/']
+sources = [SOURCELOWER_TAR_GZ]
+checksums = ['c26201de0c226cb659350b048d74f555c316df3029a0eba7a95ff9903dfac872']
+
+builddependencies = [
+    ('Autotools', '20170619', '', True),
+]
+
+preconfigopts = 'autoreconf && '
+
+common_configopts = 'FCFLAGS="-I$EBROOTIMKL/mkl/include/intel64/lp64 -nofor_main $FCFLAGS" '
+common_configopts += 'LIBS="$LIBSCALAPACK" '
+
+configopts = [
+    common_configopts + '--enable-openmp ',
+    common_configopts,  # Default version last, so we can get the normal config.h/config-f90.h installed afterwards.
+]
+
+buildopts = ' V=1 '
+
+postinstallcmds = [
+    'cp config.h config-f90.h %(installdir)s/share/doc/elpa/examples',
+]
+
+sanity_check_paths = {
+    'files': ['lib/libelpa.a', 'lib/libelpa.%s' % SHLIB_EXT, 'lib/libelpa_openmp.a',
+              'lib/libelpa_openmp.%s' % SHLIB_EXT, 'share/doc/elpa/examples/config.h',
+              'share/doc/elpa/examples/config-f90.h'],
+    'dirs': ['bin', 'include/elpa-%(version)s/elpa', 'include/elpa-%(version)s/modules', 'lib/pkgconfig'],
+}
+
+moduleclass = 'math'

e/ELPA/ELPA-2017.11.001-intel-2018a.eb

@@ -0,0 +1,46 @@
+##
+# This file is an EasyBuild reciPY as per https://github.com/easybuilders/easybuild
+#
+# Authors::   Inge Gutheil <i.gutheil@fz-juelich.de>, Alan O'Cais <a.ocais@fz-juelich.de>
+# License::   MIT/GPL
+# $Id$
+#
+##
+
+easyblock = 'ConfigureMake'
+
+name = 'ELPA'
+version = '2017.11.001'
+
+homepage = 'http://elpa.rzg.mpg.de'
+description = """Eigenvalue SoLvers for Petaflop-Applications ."""
+
+toolchain = {'name': 'intel', 'version': '2018a'}
+toolchainopts = {'usempi': True}
+
+source_urls = ['http://elpa.mpcdf.mpg.de/html/Releases/%(version)s/']
+sources = [SOURCELOWER_TAR_GZ]
+
+builddependencies = [
+    ('Autotools', '20180311', '', True),
+]
+
+preconfigopts = 'autoreconf && '
+
+common_configopts = 'FCFLAGS="-I$EBROOTIMKL/mkl/include/intel64/lp64 $FCFLAGS" '
+common_configopts += 'LIBS="$LIBSCALAPACK" '
+
+configopts = [
+    common_configopts + '--enable-openmp ',
+    common_configopts,  # Default version last, so we can get the normal config.h/config-f90.h installed afterwards.
+]
+
+buildopts = ' V=1 '
+
+sanity_check_paths = {
+    'files': ['lib/libelpa.a', 'lib/libelpa.%s' % SHLIB_EXT, 'lib/libelpa_openmp.a',
+              'lib/libelpa_openmp.%s' % SHLIB_EXT],
+    'dirs': ['bin', 'include/elpa-%(version)s/elpa', 'include/elpa-%(version)s/modules', 'lib/pkgconfig'],
+}
+
+moduleclass = 'math'

w/WIEN2k/WIEN2k-18.2-intel-2018a.eb

@@ -0,0 +1,47 @@
+# IT4Innovations 2019
+#
+#/apps/easybuild/it4i-easyblocks/easyblocks/w/wien2k.py
+
+name = 'WIEN2k'
+version = '18.2'
+
+homepage = 'http://www.wien2k.at/'
+description = """The program package WIEN2k allows to perform electronic structure calculations of solids
+using density functional theory (DFT). It is based on the full-potential (linearized) augmented plane-wave
+((L)APW) + local orbitals (lo) method, one among the most accurate schemes for band structure calculations.
+WIEN2k is an all-electron scheme including relativistic effects and has many features."""
+
+toolchain = {'name': 'intel', 'version': '2018a'}
+
+sources = ['%(name)s_%(version)s.tar.gz']
+
+dependencies = [
+    ('ELPA', '2015.02.002'),
+    ('FFTW', '3.3.7'),
+    ('libxc', '4.2.3'),
+]
+
+osdependencies = ['glib-devel']  # required for libpthread.a
+
+remote = 'pbsssh'
+wien_mpirun = 'mpirun  -np _NP_ -machinefile _HOSTS_ _EXEC_'
+use_remote = True
+mpi_remote = False
+wien_granularity = True
+taskset = 'no'
+
+tests = [
+    # test case 1: NaCl
+    ('NaCl', '-b', '-i 3', [r'^:DIS.*0.12', r'^:ENE.*-1248.14']),
+    # test case 2: TiO2
+    ('TiO2',
+     '-b -numk 1000 -rkmax 7.5',
+     '-in1ef -cc 0.00001 -fc 0.5 -i 100',
+     [
+         r'^:ENE.*-4018.07',
+         r'^:FGL001.*\s+[0.]+\s+[0.]+\s+[0.]+\s+total forces',
+         r'^:FGL002.*14.*total forces',
+     ]),
+]
+
+moduleclass = 'chem'